methyl 5-[(4-carbamimidoylphenoxy)methyl]-2-(3-carbamimidoylphenyl)benzoate

Systemtic Name: methyl 5-[(4-carbamimidoylphenoxy)methyl]-2-(3-carbamimidoylphenyl)benzoate Openeye Name: methyl 5-[(4-carbamimidoylphenoxy)methyl]-2-(3-carbamimidoylphenyl)benzoate CAS Name: 5-[(4-carbamimidoylphenoxy)methyl]-2-(3-carbamimidoylphenyl)benzoic acid methyl ester IUPAC Name: methyl 5-[(4-carbamimidoylphenoxy)methyl]-2-(3-carbamimidoylphenyl)benzoate Traditional Name: 5-[(4-amidinophenoxy)methyl]-2-(3-amidinophenyl)benzoic acid methyl ester Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)COC2=CC=C(C=C2)C(=N)N)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)COC2=CC=C(C=C2)C(=N)N)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C23H22N4O3/c1-29-23(28)20-11-14(13-30-18-8-6-15(7-9-18)21(24)25)5-10-19(20)16-3-2-4-17(12-16)22(26)27/h2-12H,13H2,1H3,(H3,24,25)(H3,26,27)